CS-1066554
2-(4-Ethynyl-3-(trifluoromethyl)-1H-pyrazol-1-yl)acetic acid
Manufacturer: ChemScene
CAS Number: 2813950-62-6
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₈H₅F₃N₂O₂
Molecular Weight
218.13
Synonyms
None
SMILES
O=C(O)CN1N=C(C(C#C)=C1)C(F)(F)F
Tpsa
55.12
Logp
0.9678
H Acceptors
3
H Donors
1
Rotatable Bonds
2
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₅F₃N₂O₂
Molecular Weight: 218.13
Synonyms: None
SMILES: O=C(O)CN1N=C(C(C#C)=C1)C(F)(F)F
Tpsa: 55.12
Logp: 0.9678
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₅F₃N₂O₂
Molecular Weight:
218.13
Synonyms:
None
SMILES:
O=C(O)CN1N=C(C(C#C)=C1)C(F)(F)F
Tpsa:
55.12
Logp:
0.9678
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₂BrN₃O
Molecular Weight: 258.12
Synonyms: None
SMILES: BrC=1C=C2[C@@]3(OCCN2N1)CCNC3
Tpsa: 39.08
Logp: 0.8644
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₂BrN₃O
Molecular Weight:
258.12
Synonyms:
None
SMILES:
BrC=1C=C2[C@@]3(OCCN2N1)CCNC3
Tpsa:
39.08
Logp:
0.8644
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₂BrN₃O
Molecular Weight: 258.12
Synonyms: None
SMILES: BrC=1C=C2[C@]3(OCCN2N1)CCNC3
Tpsa: 39.08
Logp: 0.8644
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₂BrN₃O
Molecular Weight:
258.12
Synonyms:
None
SMILES:
BrC=1C=C2[C@]3(OCCN2N1)CCNC3
Tpsa:
39.08
Logp:
0.8644
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₂₆N₂O₂
Molecular Weight: 266.38
Synonyms: None
SMILES: O=C(OC(C)(C)C)C1=NN(C(=C1)CCC)CC(C)C
Tpsa: 44.12
Logp: 3.4469
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₂₆N₂O₂
Molecular Weight:
266.38
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)C1=NN(C(=C1)CCC)CC(C)C
Tpsa:
44.12
Logp:
3.4469
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
5